SMILES:
C#Cc1cccc(Nc2ncnc3oc4c(c23)CCNC4)c1Molecular Processing
Molecular formula
C17H14N4O
Molecular weight
290.33
Exact mass
290.1168
XLogP
2.59
TPSA
62.98
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
22
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.176
Molar refractivity
84.87
Supplementary Information
Récupération des détails…
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